Complet list of 1lqc con file
Complete list of 1lqc.con file
COMMENT BEGIN
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COMMENT END
CONTACTS BETWEEN
CHAIN(S) "A"
AND
CHAIN(S) "A"
HYDROPHOBIC 2.00 3.80 208
C A 0001 MET C 2.535 C A 0002 LYS CA
C A 0001 MET C 3.095 C A 0002 LYS CB
C A 0001 MET C 3.590 C A 0002 LYS CG
C A 0001 MET C 3.748 C A 0055 GLN CD
C A 0002 LYS CA 3.176 C A 0003 PRO CD
C A 0002 LYS C 2.474 C A 0003 PRO CA
C A 0002 LYS C 3.160 C A 0003 PRO C
C A 0002 LYS C 3.694 C A 0003 PRO CB
C A 0002 LYS C 3.633 C A 0003 PRO CG
C A 0002 LYS C 2.568 C A 0003 PRO CD
C A 0002 LYS CB 3.513 C A 0003 PRO CD
C A 0002 LYS CD 3.687 H A 0006 LEU CD1
C A 0002 LYS CE 3.749 H A 0006 LEU CD1
C A 0003 PRO C 2.482 C A 0004 VAL CA
C A 0003 PRO C 3.685 C A 0004 VAL C
C A 0003 PRO C 2.973 C A 0004 VAL CB
C A 0003 PRO C 3.779 C A 0004 VAL CG2
C A 0003 PRO CD 3.627 C A 0051 ARG CG
C A 0004 VAL C 2.547 C A 0005 THR CA
C A 0004 VAL C 3.068 C A 0005 THR C
C A 0004 VAL C 3.730 C A 0005 THR CB
C A 0005 THR C 2.556 H A 0006 LEU CA
C A 0005 THR C 3.177 H A 0006 LEU C
H A 0006 LEU C 2.483 H A 0007 TYR CA
H A 0006 LEU C 3.030 H A 0007 TYR C
H A 0006 LEU CD2 3.714 H A 0020 VAL CG1
H A 0006 LEU CD2 3.536 C A 0047 TYR CZ
H A 0007 TYR C 2.471 H A 0008 ASP CA
H A 0007 TYR C 3.056 H A 0008 ASP C
H A 0007 TYR CE2 3.695 H A 0017 TYR CG
H A 0008 ASP C 2.471 H A 0009 VAL CA
H A 0008 ASP C 3.092 H A 0009 VAL C
H A 0008 ASP C 3.778 H A 0009 VAL CB
H A 0009 VAL C 2.497 H A 0010 ALA CA
H A 0009 VAL C 3.081 H A 0010 ALA C
H A 0009 VAL C 3.751 H A 0010 ALA CB
H A 0009 VAL CA 3.668 H A 0045 LEU CD1
H A 0010 ALA C 2.504 H A 0011 GLU CA
H A 0010 ALA C 3.220 H A 0011 GLU C
H A 0010 ALA C 3.777 H A 0011 GLU CB
H A 0010 ALA CA 3.724 H A 0020 VAL CG2
H A 0011 GLU C 2.489 H A 0012 TYR CA
H A 0011 GLU C 3.122 H A 0012 TYR C
H A 0011 GLU C 3.754 H A 0012 TYR CB
H A 0012 TYR C 2.483 H A 0013 ALA CA
H A 0012 TYR C 3.273 H A 0013 ALA C
H A 0012 TYR C 3.700 H A 0013 ALA CB
H A 0012 TYR CB 3.515 H A 0045 LEU CD1
H A 0012 TYR CG 3.762 H A 0045 LEU CD1
H A 0013 ALA C 2.520 C A 0014 GLY CA
H A 0013 ALA C 3.242 C A 0014 GLY C
C A 0014 GLY C 2.480 C A 0015 VAL CA
C A 0014 GLY C 3.568 C A 0015 VAL C
C A 0014 GLY C 3.372 C A 0015 VAL CB
C A 0015 VAL C 2.554 C A 0016 SER CA
C A 0015 VAL C 2.968 C A 0016 SER C
C A 0015 VAL CG2 3.708 H A 0019 THR CG2
C A 0016 SER C 2.536 H A 0017 TYR CA
C A 0016 SER C 3.111 H A 0017 TYR C
C A 0016 SER C 3.786 H A 0017 TYR CB
H A 0017 TYR C 2.463 H A 0018 GLN CA
H A 0017 TYR C 2.970 H A 0018 GLN C
H A 0018 GLN C 2.460 H A 0019 THR CA
H A 0018 GLN C 3.073 H A 0019 THR C
H A 0018 GLN C 3.761 H A 0019 THR CB
H A 0018 GLN CD 3.721 H A 0022 ARG CZ
H A 0019 THR C 2.473 H A 0020 VAL CA
H A 0019 THR C 3.063 H A 0020 VAL C
H A 0019 THR C 3.649 H A 0023 VAL CG2
H A 0019 THR CG2 3.678 H A 0034 THR CG2
H A 0020 VAL C 2.415 H A 0021 SER CA
H A 0020 VAL C 3.180 H A 0021 SER C
H A 0020 VAL C 3.729 H A 0021 SER CB
H A 0021 SER CA 3.752 H A 0022 ARG CA
H A 0021 SER C 2.451 H A 0022 ARG CA
H A 0021 SER C 3.154 H A 0022 ARG C
H A 0021 SER C 3.708 H A 0022 ARG CB
H A 0022 ARG C 2.504 H A 0023 VAL CA
H A 0022 ARG C 3.053 H A 0023 VAL C
H A 0022 ARG C 3.736 H A 0023 VAL CB
H A 0023 VAL C 2.465 H A 0024 VAL CA
H A 0023 VAL C 3.046 H A 0024 VAL C
H A 0023 VAL C 3.750 H A 0024 VAL CB
H A 0023 VAL CG1 3.774 H A 0038 VAL CG2
H A 0024 VAL C 2.484 C A 0025 ASN CA
H A 0024 VAL C 3.403 C A 0025 ASN C
H A 0024 VAL C 3.694 C A 0025 ASN CB
H A 0024 VAL CG1 3.726 C A 0050 ASN CA
C A 0025 ASN C 2.505 C A 0026 GLN CA
C A 0025 ASN C 3.263 C A 0026 GLN C
C A 0025 ASN C 3.221 C A 0026 GLN CB
C A 0026 GLN CA 3.790 C A 0027 ALA CA
C A 0026 GLN C 2.507 C A 0027 ALA CA
C A 0026 GLN C 3.045 C A 0027 ALA C
C A 0026 GLN C 3.361 C A 0027 ALA CB
C A 0027 ALA C 2.522 C A 0028 SER CA
C A 0027 ALA C 3.185 C A 0028 SER C
C A 0027 ALA C 3.300 C A 0028 SER CB
C A 0028 SER C 2.482 C A 0029 HIS CA
C A 0028 SER C 3.609 C A 0029 HIS C
C A 0028 SER C 3.569 C A 0029 HIS CB
C A 0028 SER C 3.602 C A 0029 HIS CG
C A 0029 HIS C 2.474 C A 0030 VAL CA
C A 0029 HIS C 3.664 C A 0030 VAL C
C A 0029 HIS C 3.324 C A 0030 VAL CB
C A 0030 VAL C 2.495 C A 0031 SER CA
C A 0030 VAL C 3.120 C A 0031 SER C
C A 0030 VAL C 3.766 C A 0031 SER CB
C A 0030 VAL CG1 3.757 H A 0035 ARG CG
C A 0030 VAL CG1 3.475 H A 0035 ARG CD
C A 0031 SER C 2.494 H A 0032 ALA CA
C A 0031 SER C 3.092 H A 0032 ALA C
C A 0031 SER C 3.780 H A 0032 ALA CB
H A 0032 ALA C 2.476 H A 0033 LYS CA
H A 0032 ALA C 3.098 H A 0033 LYS C
H A 0032 ALA C 3.771 H A 0033 LYS CB
H A 0032 ALA C 3.392 H A 0036 GLU CD
H A 0033 LYS C 2.505 H A 0034 THR CA
H A 0033 LYS C 3.046 H A 0034 THR C
H A 0033 LYS C 3.761 H A 0034 THR CB
H A 0034 THR C 2.496 H A 0035 ARG CA
H A 0034 THR C 3.128 H A 0035 ARG C
H A 0034 THR C 3.756 H A 0035 ARG CB
H A 0035 ARG C 2.470 H A 0036 GLU CA
H A 0035 ARG C 3.133 H A 0036 GLU C
H A 0035 ARG C 3.782 H A 0036 GLU CB
H A 0035 ARG C 3.588 H A 0039 GLU CG
H A 0035 ARG C 3.770 H A 0039 GLU CD
H A 0036 GLU C 2.494 H A 0037 LYS CA
H A 0036 GLU C 3.240 H A 0037 LYS C
H A 0036 GLU C 3.626 H A 0037 LYS CB
H A 0037 LYS C 2.498 H A 0038 VAL CA
H A 0037 LYS C 3.061 H A 0038 VAL C
H A 0037 LYS C 3.768 H A 0038 VAL CB
H A 0038 VAL C 2.530 H A 0039 GLU CA
H A 0038 VAL C 3.121 H A 0039 GLU C
H A 0038 VAL C 3.783 H A 0042 MET CG
H A 0038 VAL CG1 3.577 H A 0042 MET CE
H A 0039 GLU C 2.465 H A 0040 ALA CA
H A 0039 GLU C 3.078 H A 0040 ALA C
H A 0039 GLU C 3.736 H A 0040 ALA CB
H A 0040 ALA C 2.493 H A 0041 ALA CA
H A 0040 ALA C 3.090 H A 0041 ALA C
H A 0040 ALA C 3.755 H A 0041 ALA CB
H A 0040 ALA C 3.733 H A 0044 GLU CD
H A 0041 ALA C 2.473 H A 0042 MET CA
H A 0041 ALA C 3.172 H A 0042 MET C
H A 0041 ALA C 3.783 H A 0045 LEU CD1
H A 0042 MET CA 3.760 H A 0043 ALA CA
H A 0042 MET C 2.434 H A 0043 ALA CA
H A 0042 MET C 3.080 H A 0043 ALA C
H A 0042 MET C 3.758 H A 0043 ALA CB
H A 0043 ALA C 2.505 H A 0044 GLU CA
H A 0043 ALA C 3.203 H A 0044 GLU C
H A 0043 ALA C 3.740 H A 0044 GLU CB
H A 0044 GLU C 2.507 H A 0045 LEU CA
H A 0044 GLU C 3.454 H A 0045 LEU C
H A 0044 GLU C 3.611 H A 0045 LEU CB
H A 0044 GLU C 3.758 H A 0045 LEU CG
H A 0045 LEU C 2.495 C A 0046 ASN CA
H A 0045 LEU C 3.161 C A 0046 ASN C
H A 0045 LEU C 3.279 C A 0046 ASN CB
H A 0045 LEU C 3.244 C A 0046 ASN CG
C A 0046 ASN C 2.471 C A 0047 TYR CA
C A 0046 ASN C 3.328 C A 0047 TYR C
C A 0046 ASN C 3.676 C A 0047 TYR CB
C A 0047 TYR CA 3.790 C A 0048 ILE CA
C A 0047 TYR C 2.448 C A 0048 ILE CA
C A 0047 TYR C 3.657 C A 0048 ILE C
C A 0047 TYR C 3.249 C A 0048 ILE CB
C A 0047 TYR C 3.415 C A 0048 ILE CG1
C A 0047 TYR CD2 3.797 C A 0048 ILE C
C A 0047 TYR CE2 3.656 C A 0048 ILE C
C A 0047 TYR CE1 3.605 C A 0051 ARG CB
C A 0047 TYR CZ 3.572 C A 0051 ARG CB
C A 0048 ILE CA 2.918 C A 0049 PRO CD
C A 0048 ILE C 2.521 C A 0049 PRO CA
C A 0048 ILE C 3.143 C A 0049 PRO C
C A 0048 ILE C 3.614 C A 0049 PRO CB
C A 0048 ILE C 3.689 C A 0049 PRO CG
C A 0048 ILE C 2.505 C A 0049 PRO CD
C A 0048 ILE CB 3.779 C A 0049 PRO CD
C A 0049 PRO C 2.421 C A 0050 ASN CA
C A 0049 PRO C 3.545 C A 0050 ASN C
C A 0049 PRO C 3.541 C A 0050 ASN CB
C A 0050 ASN C 2.455 C A 0051 ARG CA
C A 0050 ASN C 3.282 C A 0051 ARG C
C A 0050 ASN C 3.696 C A 0051 ARG CB
C A 0050 ASN C 3.468 C A 0051 ARG CZ
C A 0051 ARG C 2.494 C A 0052 VAL CA
C A 0051 ARG C 3.218 C A 0052 VAL C
C A 0051 ARG C 3.745 C A 0052 VAL CB
C A 0052 VAL C 2.474 C A 0053 ALA CA
C A 0052 VAL C 3.203 C A 0053 ALA C
C A 0052 VAL C 3.728 C A 0053 ALA CB
C A 0053 ALA C 2.508 C A 0054 GLN CA
C A 0053 ALA C 3.694 C A 0054 GLN C
C A 0053 ALA C 3.351 C A 0054 GLN CB
C A 0053 ALA C 3.660 C A 0054 GLN CG
C A 0054 GLN CA 3.782 C A 0055 GLN CA
C A 0054 GLN C 2.512 C A 0055 GLN CA
C A 0054 GLN C 3.743 C A 0055 GLN C
C A 0054 GLN C 3.330 C A 0055 GLN CB
C A 0054 GLN C 3.407 C A 0055 GLN CG
C A 0054 GLN C 3.516 C A 0055 GLN CD
C A 0055 GLN C 2.475 C A 0056 LEU CA
C A 0055 GLN C 3.443 C A 0056 LEU C
C A 0055 GLN C 3.608 C A 0056 LEU CB
CHARGE_ATTR 2.00 12.00 16
H A 0011 GLU OE2 11.22 H A 0037 LYS NZ
H A 0036 GLU OE1 5.472 H A 0033 LYS NZ
H A 0036 GLU OE2 3.276 H A 0033 LYS NZ
H A 0036 GLU OE1 5.861 H A 0035 ARG NH1
H A 0036 GLU OE1 7.924 H A 0035 ARG NH2
H A 0036 GLU OE2 7.849 H A 0035 ARG NH1
H A 0036 GLU OE2 9.809 H A 0035 ARG NH2
H A 0036 GLU OE1 10.71 H A 0037 LYS NZ
H A 0036 GLU OE2 10.39 H A 0037 LYS NZ
H A 0039 GLU OE1 8.728 H A 0033 LYS NZ
H A 0039 GLU OE2 10.62 H A 0033 LYS NZ
H A 0039 GLU OE1 3.797 H A 0035 ARG NH1
H A 0039 GLU OE1 5.716 H A 0035 ARG NH2
H A 0039 GLU OE2 3.733 H A 0035 ARG NH1
H A 0039 GLU OE2 5.467 H A 0035 ARG NH2
H A 0039 GLU OE1 11.08 H A 0037 LYS NZ
CHARGE_REPU 2.00 12.00 19
C A 0002 LYS NZ 9.447 C A 0051 ARG NH1
C A 0002 LYS NZ 9.525 C A 0051 ARG NH2
H A 0008 ASP OD1 8.670 H A 0011 GLU OE1
H A 0008 ASP OD1 9.958 H A 0011 GLU OE2
H A 0008 ASP OD2 7.598 H A 0011 GLU OE1
H A 0008 ASP OD2 9.169 H A 0011 GLU OE2
H A 0008 ASP OD1 9.666 H A 0044 GLU OE1
H A 0008 ASP OD1 10.65 H A 0044 GLU OE2
H A 0008 ASP OD2 10.95 H A 0044 GLU OE1
H A 0033 LYS NZ 10.90 H A 0035 ARG NH1
H A 0033 LYS NZ 11.38 H A 0037 LYS NZ
H A 0035 ARG NH2 10.52 C A 0051 ARG NH1
H A 0035 ARG NH2 11.43 C A 0051 ARG NH2
H A 0036 GLU OE1 3.295 H A 0039 GLU OE1
H A 0036 GLU OE1 5.178 H A 0039 GLU OE2
H A 0036 GLU OE2 5.453 H A 0039 GLU OE1
H A 0036 GLU OE2 7.386 H A 0039 GLU OE2
H A 0039 GLU OE1 10.83 H A 0044 GLU OE2
H A 0039 GLU OE2 11.04 H A 0044 GLU OE2
HB_MM 2.00 3.20 102
C A 0002 LYS N 2.299 C A 0001 MET O
C A 0003 PRO N 2.251 C A 0002 LYS O
C A 0004 VAL N 3.121 C A 0002 LYS O
C A 0004 VAL N 2.272 C A 0003 PRO O
C A 0005 THR N 2.253 C A 0004 VAL O
H A 0006 LEU N 2.947 C A 0004 VAL O
H A 0006 LEU N 2.253 C A 0005 THR O
H A 0007 TYR N 2.851 C A 0005 THR O
H A 0007 TYR N 2.254 H A 0006 LEU O
H A 0008 ASP N 2.732 C A 0005 THR O
H A 0008 ASP N 2.258 H A 0007 TYR O
H A 0009 VAL N 3.048 H A 0006 LEU O
H A 0009 VAL N 2.260 H A 0008 ASP O
H A 0010 ALA N 2.979 H A 0006 LEU O
H A 0010 ALA N 2.248 H A 0009 VAL O
H A 0011 GLU N 2.812 H A 0007 TYR O
H A 0011 GLU N 2.251 H A 0010 ALA O
H A 0012 TYR N 3.015 H A 0008 ASP O
H A 0012 TYR N 2.262 H A 0011 GLU O
H A 0013 ALA N 2.873 H A 0009 VAL O
H A 0013 ALA N 2.271 H A 0012 TYR O
C A 0014 GLY N 2.742 H A 0010 ALA O
C A 0014 GLY N 3.106 H A 0011 GLU O
C A 0014 GLY N 2.253 H A 0013 ALA O
C A 0015 VAL N 2.844 H A 0010 ALA O
C A 0015 VAL N 2.254 C A 0014 GLY O
C A 0016 SER N 2.251 C A 0015 VAL O
H A 0017 TYR N 2.235 C A 0016 SER O
H A 0018 GLN N 2.910 C A 0016 SER O
H A 0018 GLN N 2.277 H A 0017 TYR O
H A 0019 THR N 3.066 C A 0016 SER O
H A 0019 THR N 3.154 H A 0017 TYR O
H A 0019 THR N 2.259 H A 0018 GLN O
H A 0020 VAL N 3.085 H A 0017 TYR O
H A 0020 VAL N 2.246 H A 0019 THR O
H A 0021 SER N 2.239 H A 0020 VAL O
H A 0022 ARG N 3.040 H A 0019 THR O
H A 0022 ARG N 2.255 H A 0021 SER O
H A 0023 VAL N 2.826 H A 0019 THR O
H A 0023 VAL N 2.952 H A 0020 VAL O
H A 0023 VAL N 2.258 H A 0022 ARG O
H A 0024 VAL N 2.949 H A 0020 VAL O
H A 0024 VAL N 2.260 H A 0023 VAL O
C A 0025 ASN N 2.260 H A 0024 VAL O
C A 0026 GLN N 3.124 H A 0022 ARG O
C A 0026 GLN N 2.831 H A 0023 VAL O
C A 0026 GLN N 2.246 C A 0025 ASN O
C A 0027 ALA N 2.853 H A 0022 ARG O
C A 0027 ALA N 3.016 C A 0025 ASN O
C A 0027 ALA N 2.262 C A 0026 GLN O
C A 0028 SER N 3.085 C A 0026 GLN O
C A 0028 SER N 2.256 C A 0027 ALA O
C A 0029 HIS N 2.890 C A 0027 ALA O
C A 0029 HIS N 2.263 C A 0028 SER O
C A 0030 VAL N 2.242 C A 0029 HIS O
C A 0031 SER N 2.254 C A 0030 VAL O
H A 0032 ALA N 2.250 C A 0031 SER O
H A 0033 LYS N 2.234 H A 0032 ALA O
H A 0034 THR N 3.190 C A 0031 SER O
H A 0034 THR N 3.127 H A 0032 ALA O
H A 0034 THR N 2.251 H A 0033 LYS O
H A 0035 ARG N 2.859 H A 0032 ALA O
H A 0035 ARG N 2.255 H A 0034 THR O
H A 0036 GLU N 2.993 H A 0032 ALA O
H A 0036 GLU N 3.159 H A 0033 LYS O
H A 0036 GLU N 2.242 H A 0035 ARG O
H A 0037 LYS N 3.014 H A 0035 ARG O
H A 0037 LYS N 2.243 H A 0036 GLU O
H A 0038 VAL N 3.011 H A 0035 ARG O
H A 0038 VAL N 2.246 H A 0037 LYS O
H A 0039 GLU N 2.748 H A 0035 ARG O
H A 0039 GLU N 2.244 H A 0038 VAL O
H A 0040 ALA N 3.071 H A 0036 GLU O
H A 0040 ALA N 2.269 H A 0039 GLU O
H A 0041 ALA N 3.038 H A 0037 LYS O
H A 0041 ALA N 3.042 H A 0038 VAL O
H A 0041 ALA N 2.260 H A 0040 ALA O
H A 0042 MET N 2.754 H A 0038 VAL O
H A 0042 MET N 3.102 H A 0040 ALA O
H A 0042 MET N 2.237 H A 0041 ALA O
H A 0043 ALA N 2.258 H A 0042 MET O
H A 0044 GLU N 3.113 H A 0041 ALA O
H A 0044 GLU N 2.253 H A 0043 ALA O
H A 0045 LEU N 3.022 H A 0041 ALA O
H A 0045 LEU N 2.257 H A 0044 GLU O
C A 0046 ASN N 3.157 H A 0043 ALA O
C A 0046 ASN N 2.268 H A 0045 LEU O
C A 0047 TYR N 3.049 H A 0042 MET O
C A 0047 TYR N 3.012 H A 0045 LEU O
C A 0047 TYR N 2.242 C A 0046 ASN O
C A 0048 ILE N 2.243 C A 0047 TYR O
C A 0049 PRO N 2.274 C A 0048 ILE O
C A 0050 ASN N 2.989 C A 0048 ILE O
C A 0050 ASN N 2.251 C A 0049 PRO O
C A 0051 ARG N 2.242 C A 0050 ASN O
C A 0052 VAL N 2.904 C A 0050 ASN O
C A 0052 VAL N 2.247 C A 0051 ARG O
C A 0053 ALA N 2.245 C A 0052 VAL O
C A 0054 GLN N 2.822 C A 0052 VAL O
C A 0054 GLN N 2.258 C A 0053 ALA O
C A 0055 GLN N 2.268 C A 0054 GLN O
C A 0056 LEU N 2.267 C A 0055 GLN O
HB_MS 2.00 3.20 13
C A 0001 MET O 2.827 C A 0055 GLN NE2
C A 0016 SER O 2.959 H A 0019 THR OG1
H A 0020 VAL N 3.006 H A 0019 THR OG1
H A 0024 VAL O 2.874 C A 0026 GLN NE2
C A 0027 ALA O 2.621 C A 0028 SER OG
C A 0029 HIS N 3.105 C A 0028 SER OG
H A 0033 LYS N 3.132 H A 0036 GLU OE2
H A 0045 LEU O 3.102 C A 0046 ASN ND2
C A 0048 ILE O 3.000 C A 0051 ARG NH1
C A 0051 ARG N 3.085 C A 0047 TYR OH
C A 0051 ARG O 2.903 C A 0047 TYR OH
C A 0053 ALA O 2.852 C A 0054 GLN NE2
C A 0056 LEU N 2.837 C A 0055 GLN OE1
HB_SS 2.00 3.20 1
H A 0044 GLU OE1 2.687 H A 0012 TYR OH
AROMATIC 0.00 8.00 1
C A 0002 LYS 7.616 C A 0047 TYR